Vitas-M small molecule compound
(1R,2S)-2-{[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK093797
SMILES O=C([C@H]1CCCC[C@H]1C(=O)O)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H28N2O5S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O5S/c23-19(17-7-3-4-8-18(17)20(24)25)21-15-9-11-16(12-10-15)28(26,27)22-13-5-1-2-6-14-22/h9-12,17-18H,1-8,13-14H2,(H,21,23)(H,24,25)/t17-,18+/m0/s1InChIKey
QYTZXQYIXFMOCW-ZWKOTPCHSA-NSynonyms
(1R2S)2((4(AZEPAN1YLSULFONYL)PHENYL)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
(1R2S)2((4(AZEPAN1YLSULFONYL)PHENYL)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3C(=O)O
InChI=1SC20H28N2O5Sc2319(17734818(17)20(24)25)211591116(121015)28(2627)221351261422h9121718H181314H2(H2123)(H2425)t1718+m0s1
MFCD03371152
O=C((C@H)1CCCC(C@H)1C(=O)O)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1
STK093797
ZINC000002550685
ZINC2550685
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